Compile Data Set for Download or QSAR

Found 496 hits with Last Name = 'reinhard' and Initial = 'ej'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Atrial natriuretic peptide receptor 3 (Homo sapiens (Human))	BDBM50016816 (CHEMBL412913 | S-S-C-F-G-G-R-I-D-R-I-G-A-Q-S-G-L-G...) Show SMILES CC[C@H](C)[C@H]1NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)CNC(=O)CNC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](CSSC[C@@H](NC(=O)CNC(=O)[C@@H](CC(C)C)NC(=O)CNC(=O)[C@@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](C)NC(=O)CNC1=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CO)[C@@H](C)CC Show InChI InChI=1S/C107H165N35O34S2/c1-8-53(5)84-102(173)124-43-79(151)125-55(7)86(157)129-64(30-31-76(109)148)92(163)138-71(47-144)90(161)123-44-81(153)127-65(35-52(3)4)88(159)122-45-82(154)128-74(100(171)134-68(39-77(110)149)96(167)139-73(49-146)98(169)133-67(37-57-21-14-11-15-22-57)95(166)130-62(24-17-33-118-106(113)114)91(162)136-70(104(175)176)38-58-26-28-59(147)29-27-58)50-177-178-51-75(140-99(170)72(48-145)137-87(158)60(108)46-143)101(172)132-66(36-56-19-12-10-13-20-56)89(160)121-41-78(150)120-42-80(152)126-61(23-16-32-117-105(111)112)93(164)142-85(54(6)9-2)103(174)135-69(40-83(155)156)97(168)131-63(94(165)141-84)25-18-34-119-107(115)116/h10-15,19-22,26-29,52-55,60-75,84-85,143-147H,8-9,16-18,23-25,30-51,108H2,1-7H3,(H2,109,148)(H2,110,149)(H,120,150)(H,121,160)(H,122,159)(H,123,161)(H,124,173)(H,125,151)(H,126,152)(H,127,153)(H,128,154)(H,129,157)(H,130,166)(H,131,168)(H,132,172)(H,133,169)(H,134,171)(H,135,174)(H,136,162)(H,137,158)(H,138,163)(H,139,167)(H,140,170)(H,141,165)(H,142,164)(H,155,156)(H,175,176)(H4,111,112,117)(H4,113,114,118)(H4,115,116,119)/t53-,54-,55+,60-,61-,62-,63-,64-,65+,66+,67-,68-,69-,70-,71+,72-,73-,74+,75?,84+,85+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	0.25	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
G. D. Searle and Company Curated by ChEMBL					Assay Description Apparent binding affinity for non-vasorelaxant receptor				J Med Chem 32: 67-72 (1989) BindingDB Entry DOI: 10.7270/Q2FN156B
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 5 (Homo sapiens (Human))	BDBM50355854 (CHEMBL1909727) Show SMILES CCN(CC)S(=O)(=O)NCCCCCNc1nc(cs1)-c1ccccn1 Show InChI InChI=1S/C17H27N5O2S2/c1-3-22(4-2)26(23,24)20-13-8-5-7-12-19-17-21-16(14-25-17)15-10-6-9-11-18-15/h6,9-11,14,20H,3-5,7-8,12-13H2,1-2H3,(H,19,21)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	1.80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Binding affinity to human cloned NPY Y5 receptor expressed in african green monkey COS7 cells by radioligand binding assay				Bioorg Med Chem Lett 21: 6500-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.072 BindingDB Entry DOI: 10.7270/Q2V1257P
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 5 (Homo sapiens (Human))	BDBM50355840 (CHEMBL1912082) Show SMILES COc1ccc(C)cc1S(=O)(=O)NCCCCCNc1nc(cs1)-c1ccccn1 Show InChI InChI=1S/C21H26N4O3S2/c1-16-9-10-19(28-2)20(14-16)30(26,27)24-13-6-3-5-12-23-21-25-18(15-29-21)17-8-4-7-11-22-17/h4,7-11,14-15,24H,3,5-6,12-13H2,1-2H3,(H,23,25)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	1.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Binding affinity to human cloned NPY Y5 receptor expressed in african green monkey COS7 cells by radioligand binding assay				Bioorg Med Chem Lett 21: 6500-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.072 BindingDB Entry DOI: 10.7270/Q2V1257P
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 5 (Homo sapiens (Human))	BDBM50355849 (CHEMBL1909722) Show SMILES CC(C)S(=O)(=O)NCCCCCNc1nc-2c(CCSc3ccccc-23)s1 Show InChI InChI=1S/C19H27N3O2S3/c1-14(2)27(23,24)21-12-7-3-6-11-20-19-22-18-15-8-4-5-9-16(15)25-13-10-17(18)26-19/h4-5,8-9,14,21H,3,6-7,10-13H2,1-2H3,(H,20,22)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Binding affinity to human cloned NPY Y5 receptor expressed in african green monkey COS7 cells by radioligand binding assay				Bioorg Med Chem Lett 21: 6500-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.072 BindingDB Entry DOI: 10.7270/Q2V1257P
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 5 (Homo sapiens (Human))	BDBM50355844 (CHEMBL1912087) Show SMILES Cc1nc(C)c(s1)S(=O)(=O)NCCCCCNc1nc(cs1)-c1ccccn1 Show InChI InChI=1S/C18H23N5O2S3/c1-13-17(27-14(2)22-13)28(24,25)21-11-6-3-5-10-20-18-23-16(12-26-18)15-8-4-7-9-19-15/h4,7-9,12,21H,3,5-6,10-11H2,1-2H3,(H,20,23)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	3.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Binding affinity to human cloned NPY Y5 receptor expressed in african green monkey COS7 cells by radioligand binding assay				Bioorg Med Chem Lett 21: 6500-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.072 BindingDB Entry DOI: 10.7270/Q2V1257P
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 5 (Homo sapiens (Human))	BDBM50355847 (CHEMBL1909720) Show SMILES CC(C)S(=O)(=O)NCCCCCNc1nc(cs1)-c1ccsc1 Show InChI InChI=1S/C15H23N3O2S3/c1-12(2)23(19,20)17-8-5-3-4-7-16-15-18-14(11-22-15)13-6-9-21-10-13/h6,9-12,17H,3-5,7-8H2,1-2H3,(H,16,18)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Binding affinity to human cloned NPY Y5 receptor expressed in african green monkey COS7 cells by radioligand binding assay				Bioorg Med Chem Lett 21: 6500-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.072 BindingDB Entry DOI: 10.7270/Q2V1257P
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 5 (Rat 6B)	BDBM50355852 (CHEMBL1909725) Show SMILES CN(C)S(=O)(=O)NCCCCCNc1nc(cs1)-c1ccccn1 Show InChI InChI=1S/C15H23N5O2S2/c1-20(2)24(21,22)18-11-6-3-5-10-17-15-19-14(12-23-15)13-8-4-7-9-16-13/h4,7-9,12,18H,3,5-6,10-11H2,1-2H3,(H,17,19)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Antagonist activity at rat NPY Y5 receptor				Bioorg Med Chem Lett 21: 6500-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.072 BindingDB Entry DOI: 10.7270/Q2V1257P
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 5 (Homo sapiens (Human))	BDBM50355852 (CHEMBL1909725) Show SMILES CN(C)S(=O)(=O)NCCCCCNc1nc(cs1)-c1ccccn1 Show InChI InChI=1S/C15H23N5O2S2/c1-20(2)24(21,22)18-11-6-3-5-10-17-15-19-14(12-23-15)13-8-4-7-9-16-13/h4,7-9,12,18H,3,5-6,10-11H2,1-2H3,(H,17,19)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Binding affinity to human cloned NPY Y5 receptor expressed in african green monkey COS7 cells by radioligand binding assay				Bioorg Med Chem Lett 21: 6500-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.072 BindingDB Entry DOI: 10.7270/Q2V1257P
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 5 (Homo sapiens (Human))	BDBM50355839 (CHEMBL1912081) Show SMILES Fc1ccccc1S(=O)(=O)NCCCCCNc1nc(cs1)-c1ccccn1 Show InChI InChI=1S/C19H21FN4O2S2/c20-15-8-2-3-10-18(15)28(25,26)23-13-6-1-5-12-22-19-24-17(14-27-19)16-9-4-7-11-21-16/h2-4,7-11,14,23H,1,5-6,12-13H2,(H,22,24)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	8	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Binding affinity to human cloned NPY Y5 receptor expressed in african green monkey COS7 cells by radioligand binding assay				Bioorg Med Chem Lett 21: 6500-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.072 BindingDB Entry DOI: 10.7270/Q2V1257P
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 5 (Homo sapiens (Human))	BDBM50355832 (CHEMBL1912068) Show SMILES CC(C)S(=O)(=O)NCCCCCNc1nc(cs1)-c1ccccn1 Show InChI InChI=1S/C16H24N4O2S2/c1-13(2)24(21,22)19-11-6-3-5-10-18-16-20-15(12-23-16)14-8-4-7-9-17-14/h4,7-9,12-13,19H,3,5-6,10-11H2,1-2H3,(H,18,20)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	12	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Binding affinity to human cloned NPY Y5 receptor expressed in african green monkey COS7 cells by radioligand binding assay				Bioorg Med Chem Lett 21: 6500-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.072 BindingDB Entry DOI: 10.7270/Q2V1257P
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 5 (Homo sapiens (Human))	BDBM50355859 (CHEMBL1912086) Show SMILES Cc1noc(C)c1S(=O)(=O)NCCCCCNc1nc(cs1)-c1ccccn1 Show InChI InChI=1S/C18H23N5O3S2/c1-13-17(14(2)26-23-13)28(24,25)21-11-6-3-5-10-20-18-22-16(12-27-18)15-8-4-7-9-19-15/h4,7-9,12,21H,3,5-6,10-11H2,1-2H3,(H,20,22)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	19	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Binding affinity to human cloned NPY Y5 receptor expressed in african green monkey COS7 cells by radioligand binding assay				Bioorg Med Chem Lett 21: 6500-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.072 BindingDB Entry DOI: 10.7270/Q2V1257P
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 5 (Homo sapiens (Human))	BDBM50355841 (CHEMBL1912083) Show SMILES O=S(=O)(NCCCCCNc1nc(cs1)-c1ccccn1)c1cccs1 Show InChI InChI=1S/C17H20N4O2S3/c22-26(23,16-8-6-12-24-16)20-11-4-1-3-10-19-17-21-15(13-25-17)14-7-2-5-9-18-14/h2,5-9,12-13,20H,1,3-4,10-11H2,(H,19,21)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	31	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Binding affinity to human cloned NPY Y5 receptor expressed in african green monkey COS7 cells by radioligand binding assay				Bioorg Med Chem Lett 21: 6500-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.072 BindingDB Entry DOI: 10.7270/Q2V1257P
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 5 (Homo sapiens (Human))	BDBM50355848 (CHEMBL1909721) Show SMILES CC(C)S(=O)(=O)NCCCCCNc1nc(cs1)-c1sc(C)nc1C Show InChI InChI=1S/C16H26N4O2S3/c1-11(2)25(21,22)18-9-7-5-6-8-17-16-20-14(10-23-16)15-12(3)19-13(4)24-15/h10-11,18H,5-9H2,1-4H3,(H,17,20)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	34	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Binding affinity to human cloned NPY Y5 receptor expressed in african green monkey COS7 cells by radioligand binding assay				Bioorg Med Chem Lett 21: 6500-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.072 BindingDB Entry DOI: 10.7270/Q2V1257P
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 5 (Homo sapiens (Human))	BDBM50355855 (CHEMBL1909728) Show SMILES O=S(=O)(NCCCCCNc1nc(cs1)-c1ccccn1)N1CCOCC1 Show InChI InChI=1S/C17H25N5O3S2/c23-27(24,22-10-12-25-13-11-22)20-9-4-1-3-8-19-17-21-16(14-26-17)15-6-2-5-7-18-15/h2,5-7,14,20H,1,3-4,8-13H2,(H,19,21)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	38	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Binding affinity to human cloned NPY Y5 receptor expressed in african green monkey COS7 cells by radioligand binding assay				Bioorg Med Chem Lett 21: 6500-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.072 BindingDB Entry DOI: 10.7270/Q2V1257P
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 5 (Homo sapiens (Human))	BDBM50355833 (CHEMBL1912071) Show SMILES O=S(=O)(NCCCCCNc1nc(cs1)-c1ccccn1)C1CC1 Show InChI InChI=1S/C16H22N4O2S2/c21-24(22,13-7-8-13)19-11-4-1-3-10-18-16-20-15(12-23-16)14-6-2-5-9-17-14/h2,5-6,9,12-13,19H,1,3-4,7-8,10-11H2,(H,18,20)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	45	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Binding affinity to human cloned NPY Y5 receptor expressed in african green monkey COS7 cells by radioligand binding assay				Bioorg Med Chem Lett 21: 6500-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.072 BindingDB Entry DOI: 10.7270/Q2V1257P
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 5 (Homo sapiens (Human))	BDBM50355834 (CHEMBL1912072) Show SMILES CCC(C)S(=O)(=O)NCCCCCNc1nc(cs1)-c1ccccn1 Show InChI InChI=1S/C17H26N4O2S2/c1-3-14(2)25(22,23)20-12-7-4-6-11-19-17-21-16(13-24-17)15-9-5-8-10-18-15/h5,8-10,13-14,20H,3-4,6-7,11-12H2,1-2H3,(H,19,21)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	49	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Binding affinity to human cloned NPY Y5 receptor expressed in african green monkey COS7 cells by radioligand binding assay				Bioorg Med Chem Lett 21: 6500-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.072 BindingDB Entry DOI: 10.7270/Q2V1257P
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 5 (Homo sapiens (Human))	BDBM50355858 (CHEMBL1909731) Show SMILES COCCN(CCOC)S(=O)(=O)NCCCCCNc1nc(cs1)-c1ccccn1 Show InChI InChI=1S/C19H31N5O4S2/c1-27-14-12-24(13-15-28-2)30(25,26)22-11-6-3-5-10-21-19-23-18(16-29-19)17-8-4-7-9-20-17/h4,7-9,16,22H,3,5-6,10-15H2,1-2H3,(H,21,23)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Binding affinity to human cloned NPY Y5 receptor expressed in african green monkey COS7 cells by radioligand binding assay				Bioorg Med Chem Lett 21: 6500-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.072 BindingDB Entry DOI: 10.7270/Q2V1257P
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 5 (Homo sapiens (Human))	BDBM50355856 (CHEMBL1909729) Show SMILES CC1CN(CC(C)O1)S(=O)(=O)NCCCCCNc1nc(cs1)-c1ccccn1 Show InChI InChI=1S/C19H29N5O3S2/c1-15-12-24(13-16(2)27-15)29(25,26)22-11-6-3-5-10-21-19-23-18(14-28-19)17-8-4-7-9-20-17/h4,7-9,14-16,22H,3,5-6,10-13H2,1-2H3,(H,21,23)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	75	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Binding affinity to human cloned NPY Y5 receptor expressed in african green monkey COS7 cells by radioligand binding assay				Bioorg Med Chem Lett 21: 6500-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.072 BindingDB Entry DOI: 10.7270/Q2V1257P
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 5 (Homo sapiens (Human))	BDBM50355825 (CHEMBL1912074) Show SMILES CS(=O)(=O)NCCCCCNc1nc(cs1)-c1ccsc1 Show InChI InChI=1S/C13H19N3O2S3/c1-21(17,18)15-7-4-2-3-6-14-13-16-12(10-20-13)11-5-8-19-9-11/h5,8-10,15H,2-4,6-7H2,1H3,(H,14,16)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Binding affinity to human cloned NPY Y5 receptor expressed in african green monkey COS7 cells by radioligand binding assay				Bioorg Med Chem Lett 21: 6500-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.072 BindingDB Entry DOI: 10.7270/Q2V1257P
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 5 (Homo sapiens (Human))	BDBM50355830 (CHEMBL1912067) Show SMILES FC(F)(F)S(=O)(=O)NCCCCCNc1nc(cs1)-c1ccccn1 Show InChI InChI=1S/C14H17F3N4O2S2/c15-14(16,17)25(22,23)20-9-4-1-3-8-19-13-21-12(10-24-13)11-6-2-5-7-18-11/h2,5-7,10,20H,1,3-4,8-9H2,(H,19,21)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	109	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Binding affinity to human cloned NPY Y5 receptor expressed in african green monkey COS7 cells by radioligand binding assay				Bioorg Med Chem Lett 21: 6500-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.072 BindingDB Entry DOI: 10.7270/Q2V1257P
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 5 (Homo sapiens (Human))	BDBM50355836 (CHEMBL1912078) Show SMILES O=S(=O)(NCCCCCNc1nc(cs1)-c1ccccn1)C1CCCCC1 Show InChI InChI=1S/C19H28N4O2S2/c24-27(25,16-9-3-1-4-10-16)22-14-7-2-6-13-21-19-23-18(15-26-19)17-11-5-8-12-20-17/h5,8,11-12,15-16,22H,1-4,6-7,9-10,13-14H2,(H,21,23)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	110	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Binding affinity to human cloned NPY Y5 receptor expressed in african green monkey COS7 cells by radioligand binding assay				Bioorg Med Chem Lett 21: 6500-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.072 BindingDB Entry DOI: 10.7270/Q2V1257P
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 5 (Homo sapiens (Human))	BDBM50355826 (CHEMBL1912075) Show SMILES Cc1nc(C)c(s1)-c1csc(NCCCCCNS(C)(=O)=O)n1 Show InChI InChI=1S/C14H22N4O2S3/c1-10-13(22-11(2)17-10)12-9-21-14(18-12)15-7-5-4-6-8-16-23(3,19)20/h9,16H,4-8H2,1-3H3,(H,15,18)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	150	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Binding affinity to human cloned NPY Y5 receptor expressed in african green monkey COS7 cells by radioligand binding assay				Bioorg Med Chem Lett 21: 6500-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.072 BindingDB Entry DOI: 10.7270/Q2V1257P
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 5 (Homo sapiens (Human))	BDBM50355831 (CHEMBL1912065) Show SMILES CCS(=O)(=O)NCCCCCNc1nc(cs1)-c1ccccn1 Show InChI InChI=1S/C15H22N4O2S2/c1-2-23(20,21)18-11-6-3-5-10-17-15-19-14(12-22-15)13-8-4-7-9-16-13/h4,7-9,12,18H,2-3,5-6,10-11H2,1H3,(H,17,19)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	150	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Binding affinity to human cloned NPY Y5 receptor expressed in african green monkey COS7 cells by radioligand binding assay				Bioorg Med Chem Lett 21: 6500-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.072 BindingDB Entry DOI: 10.7270/Q2V1257P
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 5 (Homo sapiens (Human))	BDBM50355843 (CHEMBL1912085) Show SMILES Cc1nn(C)c(C)c1S(=O)(=O)NCCCCCNc1nc(cs1)-c1ccccn1 Show InChI InChI=1S/C19H26N6O2S2/c1-14-18(15(2)25(3)24-14)29(26,27)22-12-7-4-6-11-21-19-23-17(13-28-19)16-9-5-8-10-20-16/h5,8-10,13,22H,4,6-7,11-12H2,1-3H3,(H,21,23)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	159	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Binding affinity to human cloned NPY Y5 receptor expressed in african green monkey COS7 cells by radioligand binding assay				Bioorg Med Chem Lett 21: 6500-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.072 BindingDB Entry DOI: 10.7270/Q2V1257P
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 5 (Homo sapiens (Human))	BDBM50355857 (CHEMBL1909730) Show SMILES CN1CCN(CC1)S(=O)(=O)NCCCCCNc1nc(cs1)-c1ccccn1 Show InChI InChI=1S/C18H28N6O2S2/c1-23-11-13-24(14-12-23)28(25,26)21-10-5-2-4-9-20-18-22-17(15-27-18)16-7-3-6-8-19-16/h3,6-8,15,21H,2,4-5,9-14H2,1H3,(H,20,22)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	170	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Binding affinity to human cloned NPY Y5 receptor expressed in african green monkey COS7 cells by radioligand binding assay				Bioorg Med Chem Lett 21: 6500-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.072 BindingDB Entry DOI: 10.7270/Q2V1257P
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 5 (Homo sapiens (Human))	BDBM50355824 (CHEMBL1912070) Show SMILES CS(=O)(=O)NCCCCCNc1nc(cs1)-c1cccs1 Show InChI InChI=1S/C13H19N3O2S3/c1-21(17,18)15-8-4-2-3-7-14-13-16-11(10-20-13)12-6-5-9-19-12/h5-6,9-10,15H,2-4,7-8H2,1H3,(H,14,16)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	170	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Binding affinity to human cloned NPY Y5 receptor expressed in african green monkey COS7 cells by radioligand binding assay				Bioorg Med Chem Lett 21: 6500-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.072 BindingDB Entry DOI: 10.7270/Q2V1257P
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 5 (Homo sapiens (Human))	BDBM50355838 (CHEMBL1912080) Show SMILES O=C(OCc1ccccc1)N1CCC(CC1)S(=O)(=O)NCCCCCNc1nc(cs1)-c1ccccn1 Show InChI InChI=1S/C26H33N5O4S2/c32-26(35-19-21-9-3-1-4-10-21)31-17-12-22(13-18-31)37(33,34)29-16-7-2-6-15-28-25-30-24(20-36-25)23-11-5-8-14-27-23/h1,3-5,8-11,14,20,22,29H,2,6-7,12-13,15-19H2,(H,28,30)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	240	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Binding affinity to human cloned NPY Y5 receptor expressed in african green monkey COS7 cells by radioligand binding assay				Bioorg Med Chem Lett 21: 6500-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.072 BindingDB Entry DOI: 10.7270/Q2V1257P
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 5 (Homo sapiens (Human))	BDBM50355835 (CHEMBL1912073) Show SMILES O=S(=O)(CC1CCCC1)NCCCCCNc1nc(cs1)-c1ccccn1 Show InChI InChI=1S/C19H28N4O2S2/c24-27(25,15-16-8-2-3-9-16)22-13-6-1-5-12-21-19-23-18(14-26-19)17-10-4-7-11-20-17/h4,7,10-11,14,16,22H,1-3,5-6,8-9,12-13,15H2,(H,21,23)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	250	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Binding affinity to human cloned NPY Y5 receptor expressed in african green monkey COS7 cells by radioligand binding assay				Bioorg Med Chem Lett 21: 6500-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.072 BindingDB Entry DOI: 10.7270/Q2V1257P
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 5 (Homo sapiens (Human))	BDBM50355850 (CHEMBL1909723) Show SMILES CC(C)S(=O)(=O)NCCOCCNc1nc(cs1)-c1ccccn1 Show InChI InChI=1S/C15H22N4O3S2/c1-12(2)24(20,21)18-8-10-22-9-7-17-15-19-14(11-23-15)13-5-3-4-6-16-13/h3-6,11-12,18H,7-10H2,1-2H3,(H,17,19)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	290	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Binding affinity to human cloned NPY Y5 receptor expressed in african green monkey COS7 cells by radioligand binding assay				Bioorg Med Chem Lett 21: 6500-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.072 BindingDB Entry DOI: 10.7270/Q2V1257P
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 5 (Homo sapiens (Human))	BDBM50355828 (CHEMBL1912077) Show SMILES Cc1c(sc2ccc(Cl)cc12)-c1csc(NCCCCCNS(C)(=O)=O)n1 Show InChI InChI=1S/C18H22ClN3O2S3/c1-12-14-10-13(19)6-7-16(14)26-17(12)15-11-25-18(22-15)20-8-4-3-5-9-21-27(2,23)24/h6-7,10-11,21H,3-5,8-9H2,1-2H3,(H,20,22)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	360	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Binding affinity to human cloned NPY Y5 receptor expressed in african green monkey COS7 cells by radioligand binding assay				Bioorg Med Chem Lett 21: 6500-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.072 BindingDB Entry DOI: 10.7270/Q2V1257P
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 5 (Homo sapiens (Human))	BDBM50355845 (CHEMBL1909718) Show SMILES CC(C)S(=O)(=O)NCCCCCNc1nc(cs1)-c1cccnc1 Show InChI InChI=1S/C16H24N4O2S2/c1-13(2)24(21,22)19-10-5-3-4-9-18-16-20-15(12-23-16)14-7-6-8-17-11-14/h6-8,11-13,19H,3-5,9-10H2,1-2H3,(H,18,20)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	515	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Binding affinity to human cloned NPY Y5 receptor expressed in african green monkey COS7 cells by radioligand binding assay				Bioorg Med Chem Lett 21: 6500-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.072 BindingDB Entry DOI: 10.7270/Q2V1257P
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 5 (Homo sapiens (Human))	BDBM50355823 (CHEMBL1912069) Show SMILES CS(=O)(=O)NCCCCCNc1nc(cs1)-c1ccccn1 Show InChI InChI=1S/C14H20N4O2S2/c1-22(19,20)17-10-5-2-4-9-16-14-18-13(11-21-14)12-7-3-6-8-15-12/h3,6-8,11,17H,2,4-5,9-10H2,1H3,(H,16,18)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	530	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Binding affinity to human cloned NPY Y5 receptor expressed in african green monkey COS7 cells by radioligand binding assay				Bioorg Med Chem Lett 21: 6500-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.072 BindingDB Entry DOI: 10.7270/Q2V1257P
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 5 (Homo sapiens (Human))	BDBM50355829 (CHEMBL1912066) Show SMILES CS(=O)(=O)NCCCCCNc1nc(cs1)-c1ccn(c1)S(=O)(=O)c1ccccc1 Show InChI InChI=1S/C19H24N4O4S3/c1-29(24,25)21-12-7-3-6-11-20-19-22-18(15-28-19)16-10-13-23(14-16)30(26,27)17-8-4-2-5-9-17/h2,4-5,8-10,13-15,21H,3,6-7,11-12H2,1H3,(H,20,22)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	740	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Binding affinity to human cloned NPY Y5 receptor expressed in african green monkey COS7 cells by radioligand binding assay				Bioorg Med Chem Lett 21: 6500-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.072 BindingDB Entry DOI: 10.7270/Q2V1257P
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 5 (Homo sapiens (Human))	BDBM50355853 (CHEMBL1909726) Show SMILES NS(=O)(=O)NCCCCCNc1nc(cs1)-c1ccccn1 Show InChI InChI=1S/C13H19N5O2S2/c14-22(19,20)17-9-4-1-3-8-16-13-18-12(10-21-13)11-6-2-5-7-15-11/h2,5-7,10,17H,1,3-4,8-9H2,(H,16,18)(H2,14,19,20)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	803	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Binding affinity to human cloned NPY Y5 receptor expressed in african green monkey COS7 cells by radioligand binding assay				Bioorg Med Chem Lett 21: 6500-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.072 BindingDB Entry DOI: 10.7270/Q2V1257P
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 5 (Homo sapiens (Human))	BDBM50355842 (CHEMBL1912084) Show SMILES Cn1cnc(c1)S(=O)(=O)NCCCCCNc1nc(cs1)-c1ccccn1 Show InChI InChI=1S/C17H22N6O2S2/c1-23-11-16(20-13-23)27(24,25)21-10-5-2-4-9-19-17-22-15(12-26-17)14-7-3-6-8-18-14/h3,6-8,11-13,21H,2,4-5,9-10H2,1H3,(H,19,22)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	1.12E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Binding affinity to human cloned NPY Y5 receptor expressed in african green monkey COS7 cells by radioligand binding assay				Bioorg Med Chem Lett 21: 6500-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.072 BindingDB Entry DOI: 10.7270/Q2V1257P
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 5 (Homo sapiens (Human))	BDBM50355846 (CHEMBL1909719) Show SMILES CC(C)S(=O)(=O)NCCCCCNc1nc(cs1)-c1nccnc1C Show InChI InChI=1S/C16H25N5O2S2/c1-12(2)25(22,23)20-8-6-4-5-7-19-16-21-14(11-24-16)15-13(3)17-9-10-18-15/h9-12,20H,4-8H2,1-3H3,(H,19,21)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	1.85E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Binding affinity to human cloned NPY Y5 receptor expressed in african green monkey COS7 cells by radioligand binding assay				Bioorg Med Chem Lett 21: 6500-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.072 BindingDB Entry DOI: 10.7270/Q2V1257P
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 5 (Homo sapiens (Human))	BDBM50355837 (CHEMBL1912079) Show SMILES O=S(=O)(NCCCCCNc1nc(cs1)-c1ccccn1)C1CCNCC1 Show InChI InChI=1S/C18H27N5O2S2/c24-27(25,15-7-12-19-13-8-15)22-11-4-1-3-10-21-18-23-17(14-26-18)16-6-2-5-9-20-16/h2,5-6,9,14-15,19,22H,1,3-4,7-8,10-13H2,(H,21,23)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.70E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Binding affinity to human cloned NPY Y5 receptor expressed in african green monkey COS7 cells by radioligand binding assay				Bioorg Med Chem Lett 21: 6500-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.072 BindingDB Entry DOI: 10.7270/Q2V1257P
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 5 (Homo sapiens (Human))	BDBM50355827 (CHEMBL1912076) Show SMILES CS(=O)(=O)NCCCCCNc1nc(cs1)-c1nccs1 Show InChI InChI=1S/C12H18N4O2S3/c1-21(17,18)15-6-4-2-3-5-14-12-16-10(9-20-12)11-13-7-8-19-11/h7-9,15H,2-6H2,1H3,(H,14,16)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	4.30E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Binding affinity to human cloned NPY Y5 receptor expressed in african green monkey COS7 cells by radioligand binding assay				Bioorg Med Chem Lett 21: 6500-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.072 BindingDB Entry DOI: 10.7270/Q2V1257P
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 5 (Homo sapiens (Human))	BDBM50355851 (CHEMBL1909724) Show SMILES CC(C)S(=O)(=O)N1CCN(CCNc2nc(cs2)-c2ccccn2)CC1 Show InChI InChI=1S/C17H25N5O2S2/c1-14(2)26(23,24)22-11-9-21(10-12-22)8-7-19-17-20-16(13-25-17)15-5-3-4-6-18-15/h3-6,13-14H,7-12H2,1-2H3,(H,19,20)	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Binding affinity to human cloned NPY Y5 receptor expressed in african green monkey COS7 cells by radioligand binding assay				Bioorg Med Chem Lett 21: 6500-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.072 BindingDB Entry DOI: 10.7270/Q2V1257P
					More data for this Ligand-Target Pair
Ileal sodium/bile acid cotransporter (Homo sapiens (Human))	BDBM50140282 (1-{4-[4-((4R,5R)-3,3-Dibutyl-7-dimethylamino-4-hyd...) Show SMILES CCCCC1(CCCC)CS(=O)(=O)c2ccc(cc2[C@H]([C@H]1O)c1ccc(OCc2ccc(C[N+]34CCN(CC3)CC4)cc2)cc1)N(C)C Show InChI InChI=1S/C40H56N3O4S/c1-5-7-19-40(20-8-6-2)30-48(45,46)37-18-15-34(41(3)4)27-36(37)38(39(40)44)33-13-16-35(17-14-33)47-29-32-11-9-31(10-12-32)28-43-24-21-42(22-25-43)23-26-43/h9-18,27,38-39,44H,5-8,19-26,28-30H2,1-4H3/q+1/t38-,39-/m1/s1	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.280	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description In vitro inhibition of ASBT mediated uptake of [14C]taurocholate (5 uM) in baby hamster cells expressing human IBAT				J Med Chem 48: 5853-68 (2005) Article DOI: 10.1021/jm0402162 BindingDB Entry DOI: 10.7270/Q22V2GW2
					More data for this Ligand-Target Pair
Ileal sodium/bile acid cotransporter (Homo sapiens (Human))	BDBM50172695 (CHEMBL370103 | {2-[3-((4R,5R)-3,3-Dibutyl-7-dimeth...) Show SMILES CCCCC1(CCCC)CS(=O)(=O)c2ccc(cc2[C@H]([C@H]1O)c1cccc(NCC(=O)NCC(O)=O)c1)N(C)C Show InChI InChI=1S/C30H43N3O6S/c1-5-7-14-30(15-8-6-2)20-40(38,39)25-13-12-23(33(3)4)17-24(25)28(29(30)37)21-10-9-11-22(16-21)31-18-26(34)32-19-27(35)36/h9-13,16-17,28-29,31,37H,5-8,14-15,18-20H2,1-4H3,(H,32,34)(H,35,36)/t28-,29-/m1/s1	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.300	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description In vitro inhibition of ASBT mediated uptake of [14C]taurocholate (5 uM) in baby hamster cells expressing human IBAT				J Med Chem 48: 5853-68 (2005) Article DOI: 10.1021/jm0402162 BindingDB Entry DOI: 10.7270/Q22V2GW2
					More data for this Ligand-Target Pair
Ileal sodium/bile acid cotransporter (Homo sapiens (Human))	BDBM50172649 (1-{5-[4-((4R,5R)-3,3-Dibutyl-7-dimethylamino-4-hyd...) Show SMILES CCCCC1(CCCC)CS(=O)(=O)c2ccc(cc2[C@H]([C@H]1O)c1ccc(OCCCCC[N+]23CCN(CC2)CC3)cc1)N(C)C Show InChI InChI=1S/C37H58N3O4S/c1-5-7-18-37(19-8-6-2)29-45(42,43)34-17-14-31(38(3)4)28-33(34)35(36(37)41)30-12-15-32(16-13-30)44-27-11-9-10-23-40-24-20-39(21-25-40)22-26-40/h12-17,28,35-36,41H,5-11,18-27,29H2,1-4H3/q+1/t35-,36-/m1/s1	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	0.5	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description In vitro inhibition of ASBT mediated uptake of [14C]taurocholate (5 uM) in baby hamster cells expressing human IBAT				J Med Chem 48: 5853-68 (2005) Article DOI: 10.1021/jm0402162 BindingDB Entry DOI: 10.7270/Q22V2GW2
					More data for this Ligand-Target Pair
Ileal sodium/bile acid cotransporter (Homo sapiens (Human))	BDBM50172702 (4-[4-((4R,5R)-3,3-Dibutyl-7-dimethylamino-4-hydrox...) Show SMILES CCCCC1(CCCC)CS(=O)(=O)c2ccc(cc2[C@H]([C@H]1O)c1ccc(OCc2cc[n+](C)cc2)cc1)N(C)C Show InChI InChI=1S/C33H45N2O4S/c1-6-8-18-33(19-9-7-2)24-40(37,38)30-15-12-27(34(3)4)22-29(30)31(32(33)36)26-10-13-28(14-11-26)39-23-25-16-20-35(5)21-17-25/h10-17,20-22,31-32,36H,6-9,18-19,23-24H2,1-5H3/q+1/t31-,32-/m1/s1	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	0.75	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description In vitro inhibition of ASBT mediated uptake of [14C]taurocholate (5 uM) in baby hamster cells expressing human IBAT				J Med Chem 48: 5853-68 (2005) Article DOI: 10.1021/jm0402162 BindingDB Entry DOI: 10.7270/Q22V2GW2
					More data for this Ligand-Target Pair
Ileal sodium/bile acid cotransporter (Homo sapiens (Human))	BDBM50370667 (CHEMBL555246) Show SMILES CCCCC1(CCCC)CS(=O)(=O)c2ccc(cc2[C@H]([C@H]1O)c1cccc(NC(=O)CCCC[N+](CC)(CC)CC)c1)N(C)C |r| Show InChI InChI=1S/C37H59N3O4S/c1-8-13-23-37(24-14-9-2)28-45(43,44)33-22-21-31(39(6)7)27-32(33)35(36(37)42)29-18-17-19-30(26-29)38-34(41)20-15-16-25-40(10-3,11-4)12-5/h17-19,21-22,26-27,35-36,42H,8-16,20,23-25,28H2,1-7H3/p+1/t35-,36-/m1/s1	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.760	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description In vitro inhibition of ASBT mediated uptake of [14C]taurocholate (5 uM) in baby hamster cells expressing human IBAT				J Med Chem 48: 5853-68 (2005) Article DOI: 10.1021/jm0402162 BindingDB Entry DOI: 10.7270/Q22V2GW2
					More data for this Ligand-Target Pair
Cholesteryl ester transfer protein (Homo sapiens (Human))	BDBM50128131 ((R)-3-((3-(1,1,2,2-tetrafluoroethoxy)benzyl)(3-(4-...) Show SMILES CCc1cc(Oc2cccc(c2)N(C[C@@H](O)C(F)(F)F)Cc2cccc(OC(F)(F)C(F)F)c2)ccc1Cl Show InChI InChI=1S/C26H23ClF7NO3/c1-2-17-12-20(9-10-22(17)27)37-19-7-4-6-18(13-19)35(15-23(36)25(30,31)32)14-16-5-3-8-21(11-16)38-26(33,34)24(28)29/h3-13,23-24,36H,2,14-15H2,1H3/t23-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	0.770	n/a	n/a	n/a	n/a	n/a	n/a
Pharmacia Discovery Research (Pfizer Global Research and Development) Curated by ChEMBL					Assay Description Compound was tested in vitro for inhibitory activity against recombinant human cholesteryl ester transfer protein in buffer with <1 nM [CETP] for 18 ...				J Med Chem 46: 2152-68 (2003) Article DOI: 10.1021/jm020528+ BindingDB Entry DOI: 10.7270/Q2QV3KWK
					More data for this Ligand-Target Pair
Type-1 angiotensin II receptor A/B (RAT)	BDBM50452851 (CHEMBL2373017) Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCSSCC[C@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)CNC)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N1)C(O)=O |wU:8.7,4.4,15.16,53.55,2.1,wD:32.34,25.26,36.38,(-13.57,-1.73,;-12.05,-1.44,;-11.05,-2.61,;-11.56,-4.06,;-9.54,-2.32,;-8.53,-3.49,;-7.02,-3.2,;-6.51,-1.75,;-6.01,-4.37,;-6.36,-5.86,;-5.05,-6.66,;-3.88,-5.66,;-4.48,-4.24,;-3.68,-2.92,;-4.42,-1.57,;-2.14,-2.95,;-1.02,-4.01,;-1.37,-5.51,;-.36,-6.68,;-1.16,-7.99,;-2.66,-7.64,;-2.79,-6.1,;-1.34,-1.64,;.2,-1.67,;.94,-3.02,;1,-.35,;.23,.98,;1,2.31,;.23,3.65,;1,4.98,;2.54,4.98,;3.31,3.65,;4.85,3.65,;5.62,4.98,;7.16,4.98,;7.93,3.65,;7.93,6.31,;7.16,7.65,;7.93,8.98,;7.16,10.31,;7.93,11.65,;7.16,12.98,;7.93,14.32,;5.62,12.98,;9.47,6.31,;10.24,7.65,;9.47,8.98,;11.78,7.65,;12.55,8.98,;14.09,8.98,;5.62,2.31,;7.16,2.35,;4.84,.82,;5.16,-.69,;6.57,-1.31,;6.73,-2.85,;8.14,-3.47,;8.3,-5,;7.05,-5.91,;7.21,-7.44,;5.64,-5.28,;5.48,-3.75,;3.83,-1.46,;3.67,-2.99,;2.68,-.43,;-9.03,-.87,;-7.51,-.58,;-10.03,.3,)| Show InChI InChI=1S/C43H65N13O10S2/c1-4-24(2)35(42(65)66)55-40(63)33-8-6-16-56(33)41(64)32(20-26-21-47-23-49-26)54-38(61)30-14-18-68-67-17-13-29(37(60)53-31(39(62)52-30)19-25-9-11-27(57)12-10-25)51-36(59)28(50-34(58)22-46-3)7-5-15-48-43(44)45/h9-12,21,23-24,28-33,35,46,57H,4-8,13-20,22H2,1-3H3,(H,47,49)(H,50,58)(H,51,59)(H,52,62)(H,53,60)(H,54,61)(H,55,63)(H,65,66)(H4,44,45,48)/t24-,28-,29-,30-,31-,32-,33-,35-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	0.900	n/a	n/a	n/a	n/a	n/a	n/a
G. D. Searle and Company Curated by ChEMBL					Assay Description Concentration required to 50% inhibition in specific binding of [125- I]A-II to Angiotensin II receptor in rat uterine membrane				J Med Chem 33: 1935-40 (1990) BindingDB Entry DOI: 10.7270/Q2R78D70
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 2 (Homo sapiens (Human))	BDBM50049011 (4-[6-(3,4-Dichloro-phenyl)-spiro[2.4]hept-5-en-5-y...) Show SMILES NS(=O)(=O)c1ccc(cc1)C1=C(CC2(CC2)C1)c1ccc(Cl)c(Cl)c1 |t:11| Show InChI InChI=1S/C19H17Cl2NO2S/c20-17-6-3-13(9-18(17)21)16-11-19(7-8-19)10-15(16)12-1-4-14(5-2-12)25(22,23)24/h1-6,9H,7-8,10-11H2,(H2,22,23,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
Searle Research and Development Curated by ChEMBL					Assay Description Inhibitory activity of the compound against prostaglandin G/H synthase 2 (COX-2).				J Med Chem 39: 253-66 (1996) Article DOI: 10.1021/jm950664x BindingDB Entry DOI: 10.7270/Q2XG9Q6M
					More data for this Ligand-Target Pair
Ileal sodium/bile acid cotransporter (Homo sapiens (Human))	BDBM50172668 (1-{4-[4-((4R,5R)-3,3-Dibutyl-7-dimethylamino-4-hyd...) Show SMILES CCCCC1(CCCC)CS(=O)(=O)c2ccc(cc2[C@H]([C@H]1O)c1ccc(OCc2ccc(C[n+]3ccccc3)cc2)cc1)N(C)C Show InChI InChI=1S/C39H49N2O4S/c1-5-7-22-39(23-8-6-2)29-46(43,44)36-21-18-33(40(3)4)26-35(36)37(38(39)42)32-16-19-34(20-17-32)45-28-31-14-12-30(13-15-31)27-41-24-10-9-11-25-41/h9-21,24-26,37-38,42H,5-8,22-23,27-29H2,1-4H3/q+1/t37-,38-/m1/s1	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description In vitro inhibition of ASBT mediated uptake of [14C]taurocholate (5 uM) in baby hamster cells expressing human IBAT				J Med Chem 48: 5853-68 (2005) Article DOI: 10.1021/jm0402162 BindingDB Entry DOI: 10.7270/Q22V2GW2
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 2 (Homo sapiens (Human))	BDBM50049025 (4-[6-(4-Methoxy-phenyl)-spiro[2.4]hept-5-en-5-yl]-...) Show SMILES COc1ccc(cc1)C1=C(CC2(CC2)C1)c1ccc(cc1)S(N)(=O)=O |t:9| Show InChI InChI=1S/C20H21NO3S/c1-24-16-6-2-14(3-7-16)18-12-20(10-11-20)13-19(18)15-4-8-17(9-5-15)25(21,22)23/h2-9H,10-13H2,1H3,(H2,21,22,23)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
Searle Research and Development Curated by ChEMBL					Assay Description Inhibitory activity of the compound against prostaglandin G/H synthase 2 (COX-2).				J Med Chem 39: 253-66 (1996) Article DOI: 10.1021/jm950664x BindingDB Entry DOI: 10.7270/Q2XG9Q6M
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 2 (Homo sapiens (Human))	BDBM50049014 (4-[6-(4-Chloro-phenyl)-spiro[2.4]hept-5-en-5-yl]-b...) Show SMILES NS(=O)(=O)c1ccc(cc1)C1=C(CC2(CC2)C1)c1ccc(Cl)cc1 |t:11| Show InChI InChI=1S/C19H18ClNO2S/c20-15-5-1-13(2-6-15)17-11-19(9-10-19)12-18(17)14-3-7-16(8-4-14)24(21,22)23/h1-8H,9-12H2,(H2,21,22,23)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
Searle Research and Development Curated by ChEMBL					Assay Description Inhibitory activity of the compound against prostaglandin G/H synthase 2 (COX-2).				J Med Chem 39: 253-66 (1996) Article DOI: 10.1021/jm950664x BindingDB Entry DOI: 10.7270/Q2XG9Q6M
					More data for this Ligand-Target Pair

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